SCHEMBL29196236

SCHEMBL29196236

CCCCCc1ccc(C(=O)Cl)c(OC)c1

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.74
PPARG P37231 1/20 0.74
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2C8 P10632 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2B6 P20813 2/20 0.51
CYP2C19 P33261 2/20 0.51
LTA4H P09960 2/20 0.48
KAT8 Q9H7Z6 2/20 0.48
HTR1A P08908 3/20 0.47
CYP2E1 P05181 1/20 0.47
ALOX5 P09917 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2A6 P11509 1/20 0.47
TRPV1 Q8NER1 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29196246 0.89 PPARG (0.58) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL31065733 0.85 PPARA (1.00) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL20504238 0.85 PPARA (1.00) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL3298521 0.85 PPARA (1.00) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL29196259 0.83 PPARG (0.50) PPARAPPARGALOX5
SCHEMBL7799996 0.82 PPARA (0.89) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL7801348 0.81 PPARG (0.68) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL4292099 0.80 PPARA (0.74) PPARAPPARGCYP1A2CYP3A4CYP2C8
SCHEMBL9295122 0.80 TTR (0.47) PPARAPPARGALOX5
SCHEMBL29196242 0.79 PPARG (0.48) PPARAPPARGCYP1A2CYP3A4CYP2C9

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924555-A Catalyst component, catalyst system, application of catalyst system and olefin polymerization method 中国石油化工股份有限公司 2024-04-26 CN disclosed
CN-117924556-A Spherical magnesium halide adduct and preparation method and application thereof 中国石油化工股份有限公司 2024-04-26 CN disclosed